1-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile

Base Information

• Chemical Name: 1-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile
• CAS No.: 338399-20-5
• Molecular Formula: C12H7ClF3N5O2
• Molecular Weight: 345.66
• DSSTox Substance ID: DTXSID301108228
• Mol file: 338399-20-5.mol

Synonyms:338399-20-5;1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile;1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-methylamino]-2,4-dioxopyrimidine-5-carbonitrile;1-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile;DTXSID301108228;MFCD00172964;AKOS005085099;2H-911;1-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl] (methyl)amino]-2,4-dioxo-1,2,3,4-tetrahydro-5- pyrimidinecarbonitrile;1-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]methylamino]-1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinecarbonitrile

Chemical Property of 1-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 345.0240367
• Heavy Atom Count: 23
• Complexity: 599

Purity/Quality:

97% ^*data from raw suppliers

1-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN(C1=C(C=C(C=N1)C(F)(F)F)Cl)N2C=C(C(=O)NC2=O)C#N